2-[5-[(2-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyrazine

Systemtic Name: 2-[5-[(2-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[5-(o-tolylmethylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[5-[(2-methylphenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[5-[(2-methylphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[5-[(2-methylbenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyrazine Formula: C20H17N5S MolecularWeight: 359.44748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C3=CC=CC=C3)C4=NC=CN=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C3=CC=CC=C3)C4=NC=CN=C4

InChI

InChI=1S/C20H17N5S/c1-15-7-5-6-8-16(15)14-26-20-24-23-19(18-13-21-11-12-22-18)25(20)17-9-3-2-4-10-17/h2-13H,14H2,1H3